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Ingredients

Corilagin

C27H22O18

Entity Type
Ingredients
Relation Groups
2
Relation Preview
16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Corilagin
Molecular Formula
C27H22O18
Molecular Weight
No data
Canonical SMILES
C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)O)O
Isomeric SMILES
C1[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)O)O
InChI
InChI=1S/C27H22O18/c28-9-1-6(2-10(29)16(9)32)24(39)45-27-22(38)23-19(35)13(43-27)5-42-25(40)7-3-11(30)17(33)20(36)14(7)15-8(26(41)44-23)4-12(31)18(34)21(15)37/h1-4,13,19,22-23,27-38H,5H2/t13-,19-,22-,23+,27+/m1/s1
Oral Bioavailability
3.014
Drug Likeness
0.098
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

Direct relations and traceable candidates grouped by relation type.

Active Targets

ingredient target8 Targets
01
ABCB11
ATP binding cassette subfamily B member 11
ATP binding cassette subfamily B member 11
02
ABCC2
ATP binding cassette subfamily C member 2
ATP binding cassette subfamily C member 2
05
AKR1C3
aldo-keto reductase family 1 member C3
aldo-keto reductase family 1 member C3
06
AKR1C3
aldo-keto reductase family 1 member C3
aldo-keto reductase family 1 member C3
07
ALDH2
aldehyde dehydrogenase 2 family member
aldehyde dehydrogenase 2 family member
08
ALDH2
aldehyde dehydrogenase 2 family member
aldehyde dehydrogenase 2 family member